Processed databases
Atom-Mass pairs
Outputs for Pyridoxine; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001639
Synonyms: Pyridoxine, Pyridoxol
Total mass: 169.1774
Formula: H11 C8 O3 N1
Experimental information
MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: NEGATIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 80.1, 93.3, 94.3, 106.9, 108.0, 120.9, 123.0, 135.8,
Processing time: 0:00:02.406821
Results for the quried mass "78.7"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C4O1N1 | 0.357 | 1 | 0 | C1,C2,C5,C8,N9,O12 |
| C5N1 | 0.400 | 5 | 2 | C2,C4,C5,C7,C8,N9 |
| C5N1 | 0.400 | 5 | 2 | C2,C3,C5,C6,C8,N9 |
| C5N1 | 0.400 | 5 | 2 | C2,C4,C5,C6,C7,N9 |
| C5N1 | 0.400 | 5 | 2 | C2,C3,C5,C6,C7,N9 |
| C5N1 | 0.400 | 5 | 0 | C2,C3,C4,C6,C7,N9 |
| C5N1 | 0.400 | 5 | 2 | C2,C3,C6,C7,C8,N9 |
| C5N1 | 0.400 | 5 | 2 | C2,C4,C6,C7,C8,N9 |
| C5N1 | 0.400 | 5 | 1 | C1,C2,C5,C6,C7,N9 |
| C5N1 | 0.400 | 5 | 1 | C1,C2,C5,C6,C8,N9 |
| C5N1 | 0.400 | 5 | 2 | C1,C5,C6,C7,C8,N9 |
| C5O1 | 0.377 | 3 | 0 | C2,C3,C4,C6,C7,O11 |
| C5O1 | 0.377 | 3 | 0 | C2,C3,C6,C7,C8,O12 |
| C5O1 | 0.377 | 3 | 0 | C2,C3,C4,C6,C7,O10 |
| C5O1 | 0.377 | 3 | 0 | C2,C3,C6,C7,C8,O10 |
| C5O1 | 0.377 | 3 | 0 | C2,C4,C6,C7,C8,O12 |
| C5O1 | 0.377 | 3 | 0 | C2,C4,C6,C7,C8,O11 |
| C5O1 | 0.377 | 3 | 1 | C2,C5,C6,C7,C8,O12 |
| C5O1 | 0.377 | 3 | 0 | C3,C4,C6,C7,C8,O12 |
| C5O1 | 0.377 | 3 | 0 | C3,C4,C6,C7,C8,O11 |
| C5O1 | 0.377 | 3 | 0 | C3,C5,C6,C7,C8,O12 |
| C5O1 | 0.377 | 3 | 0 | C3,C5,C6,C7,C8,O10 |
| C5O1 | 0.377 | 3 | 0 | C3,C4,C6,C7,C8,O10 |
| C5O1 | 0.377 | 3 | 0 | C4,C5,C6,C7,C8,O11 |
| C5O1 | 0.377 | 3 | 0 | C1,C4,C5,C7,C8,O11 |
| C5O1 | 0.377 | 3 | 0 | C1,C5,C6,C7,C8,O12 |
| C4O2 | 0.334 | 1 | 0 | C3,C4,C6,C7,O10,O11 |